N-[(2-chloranyl-4-iodanyl-phenyl)carbamothioyl]-4-nitro-benzamide

Systemtic Name: N-[(2-chloranyl-4-iodanyl-phenyl)carbamothioyl]-4-nitro-benzamide Openeye Name: N-[(2-chloro-4-iodo-phenyl)carbamothioyl]-4-nitro-benzamide CAS Name: N-[(2-chloro-4-iodoanilino)-sulfanylidenemethyl]-4-nitrobenzamide IUPAC Name: N-[(2-chloro-4-iodophenyl)carbamothioyl]-4-nitrobenzamide Traditional Name: N-[(2-chloro-4-iodo-phenyl)thiocarbamoyl]-4-nitro-benzamide Formula: C14H9ClIN3O3S MolecularWeight: 461.66203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(=S)NC2=C(C=C(C=C2)I)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(=S)NC2=C(C=C(C=C2)I)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H9ClIN3O3S/c15-11-7-9(16)3-6-12(11)17-14(23)18-13(20)8-1-4-10(5-2-8)19(21)22/h1-7H,(H2,17,18,20,23)